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Merck

108421

Sigma-Aldrich

Methyl cyanoacetate

99%

Sinónimos:

Methyl 2-cyanoacetate

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About This Item

Fórmula lineal:
NCCH2COOCH3
Número de CAS:
Peso molecular:
99.09
Beilstein/REAXYS Number:
773945
EC Number:
MDL number:
UNSPSC Code:
12352100
eCl@ss:
39031513
PubChem Substance ID:
NACRES:
NA.22

vapor density

3.41 (vs air)

Quality Level

vapor pressure

0.2 mmHg ( 20 °C)

assay

99%

refractive index

n20/D 1.417 (lit.)

bp

204-207 °C (lit.)

mp

−13 °C (lit.)

density

1.123 g/mL at 25 °C (lit.)

functional group

ester
nitrile

SMILES string

COC(=O)CC#N

InChI

1S/C4H5NO2/c1-7-4(6)2-3-5/h2H2,1H3

InChI key

ANGDWNBGPBMQHW-UHFFFAOYSA-N

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General description

Methyl cyanoacetate is the intermediate product in pharmaceutical organic synthesis as well as in the synthesis of some biologically active compounds used in agriculture. It undergoes calcite or fluorite catalyzed Knövenagel condensation with aromatic aldehydes, giving the corresponding arylidenemalononitriles and (E)-α-cyanocinnamic esters.

Application

Methyl cyanoacetate may be used in the synthesis of various 1,2,5-tricarbonyl compounds.

pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Eye Irrit. 2

Storage Class

10 - Combustible liquids

wgk_germany

WGK 1

flash_point_f

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

Eyeshields, Gloves


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